6-[4-(aminomethyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-azanyl-4-cyclopropyl-7-fluoranyl-5-methyl-pyrido[1,2-c]pyrimidine-1,3-dione

Systemtic Name: 6-[4-(aminomethyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-azanyl-4-cyclopropyl-7-fluoranyl-5-methyl-pyrido[1,2-c]pyrimidine-1,3-dione Openeye Name: 2-amino-6-[4-(aminomethyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-4-cyclopropyl-7-fluoro-5-methyl-pyrido[1,2-c]pyrimidine-1,3-dione CAS Name: 2-amino-6-[4-(aminomethyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-cyclopropyl-7-fluoro-5-methylpyrido[1,2-c]pyrimidine-1,3-dione IUPAC Name: 2-amino-6-[4-(aminomethyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-cyclopropyl-7-fluoro-5-methylpyrido[1,2-c]pyrimidine-1,3-dione Traditional Name: 2-amino-6-[4-(aminomethyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-4-cyclopropyl-7-fluoro-5-methyl-pyrido[1,2-c]pyrimidine-1,3-quinone Formula: C21H23FN4O2S MolecularWeight: 414.496323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN2C1=C(C(=O)N(C2=O)N)C3CC3)F)C4=CC5=C(S4)CCCC5CN

Isomeric SMILES

CC1=C(C(=CN2C1=C(C(=O)N(C2=O)N)C3CC3)F)C4=CC5=C(S4)CCCC5CN

InChI

InChI=1S/C21H23FN4O2S/c1-10-17(16-7-13-12(8-23)3-2-4-15(13)29-16)14(22)9-25-19(10)18(11-5-6-11)20(27)26(24)21(25)28/h7,9,11-12H,2-6,8,23-24H2,1H3