N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-ethyl-2-[(5-methylthiophen-2-yl)methyl-phenethyl-amino]ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-ethyl-2-[(5-methylthiophen-2-yl)methyl-phenethyl-amino]ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-ethyl-2-[(5-methyl-2-thienyl)methyl-phenethyl-amino]acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-ethyl-2-[(5-methyl-2-thiophenyl)methyl-phenethylamino]acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-ethyl-2-[(5-methylthiophen-2-yl)methyl-phenethylamino]acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-ethyl-2-[(5-methyl-2-thienyl)methyl-phenethyl-amino]acetamide Formula: C26H35N5O3S MolecularWeight: 497.6528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)CN(CCC2=CC=CC=C2)CC3=CC=C(S3)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)CN(CCC2=CC=CC=C2)CC3=CC=C(S3)C)N

InChI

InChI=1S/C26H35N5O3S/c1-4-6-15-31-24(27)23(25(33)28-26(31)34)30(5-2)22(32)18-29(17-21-13-12-19(3)35-21)16-14-20-10-8-7-9-11-20/h7-13H,4-6,14-18,27H2,1-3H3,(H,28,33,34)