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

Systemtic Name: N-(1-aminocarbonyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)-3-azanyl-6-methyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(1-carbamoyl-4,5-dihydrobenzo[e]benzothiophen-2-yl)-6-methyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(1-carbamoyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)-6-methyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(1-carbamoyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)-6-methylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(1-carbamoyl-4,5-dihydrobenzo[e]benzothiophen-2-yl)-6-methyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C22H18N4O2S2 MolecularWeight: 434.53392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C4=C(S3)CCC5=CC=CC=C54)C(=O)N)N

Isomeric SMILES

CC1=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/C22H18N4O2S2/c1-10-6-8-13-17(23)18(30-21(13)25-10)20(28)26-22-16(19(24)27)15-12-5-3-2-4-11(12)7-9-14(15)29-22/h2-6,8H,7,9,23H2,1H3,(H2,24,27)(H,26,28)