N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(2-thienyl)cinchoninamide Formula: C30H23N3OS3 MolecularWeight: 537.71812

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=CS7

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C5=CC(=NC6=CC=CC=C65)C7=CC=CS7

InChI

InChI=1S/C30H23N3OS3/c1-17-12-13-19-26(15-17)37-30(27(19)29-32-22-9-4-5-10-25(22)36-29)33-28(34)20-16-23(24-11-6-14-35-24)31-21-8-3-2-7-18(20)21/h2-11,14,16-17H,12-13,15H2,1H3,(H,33,34)