N-(1-aminocarbonyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)-3-azanyl-6-propyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: N-(1-aminocarbonyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)-3-azanyl-6-propyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(1-carbamoyl-4,5-dihydrobenzo[e]benzothiophen-2-yl)-6-propyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(1-carbamoyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)-6-propyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(1-carbamoyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(1-carbamoyl-4,5-dihydrobenzo[e]benzothiophen-2-yl)-6-propyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C24H22N4O2S2 MolecularWeight: 462.58708

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C4=C(S3)CCC5=CC=CC=C54)C(=O)N)N

Isomeric SMILES

CCCC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C4=C(S3)CCC5=CC=CC=C54)C(=O)N)N

InChI

InChI=1S/C24H22N4O2S2/c1-2-5-13-9-10-15-19(25)20(32-23(15)27-13)22(30)28-24-18(21(26)29)17-14-7-4-3-6-12(14)8-11-16(17)31-24/h3-4,6-7,9-10H,2,5,8,11,25H2,1H3,(H2,26,29)(H,28,30)