2-[4-azanyl-5-(dimethylamino)-3-methyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]-N-[3-(4-methylphenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide

Systemtic Name: 2-[4-azanyl-5-(dimethylamino)-3-methyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]-N-[3-(4-methylphenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide Openeye Name: 2-[4-amino-5-(dimethylamino)-3-methyl-2,6-dioxo-pyrimidin-1-yl]-N-[3-(4-methylbenzoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]acetamide CAS Name: 2-[4-amino-5-(dimethylamino)-3-methyl-2,6-dioxo-1-pyrimidinyl]-N-[3-[(4-methylphenyl)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide IUPAC Name: 2-[4-amino-5-(dimethylamino)-3-methyl-2,6-dioxopyrimidin-1-yl]-N-[3-(4-methylbenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide Traditional Name: 2-[4-amino-5-(dimethylamino)-2,6-diketo-3-methyl-pyrimidin-1-yl]-N-(3-p-toluoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C25H29N5O4S MolecularWeight: 495.59386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4C(=O)C(=C(N(C4=O)C)N)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4C(=O)C(=C(N(C4=O)C)N)N(C)C

InChI

InChI=1S/C25H29N5O4S/c1-14-9-11-15(12-10-14)21(32)19-16-7-5-6-8-17(16)35-23(19)27-18(31)13-30-24(33)20(28(2)3)22(26)29(4)25(30)34/h9-12H,5-8,13,26H2,1-4H3,(H,27,31)