N-(3-methoxypropyl)-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-4-nitro-benzamide

Systemtic Name: N-(3-methoxypropyl)-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: N-(3-methoxypropyl)-4-nitro-N-[2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]benzamide CAS Name: N-(3-methoxypropyl)-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-(3-methoxypropyl)-N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-4-nitrobenzamide Traditional Name: N-[2-keto-2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]-N-(3-methoxypropyl)-4-nitro-benzamide Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C3=C(CCN2C(=O)CN(CCCOC)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])SC=C3

Isomeric SMILES

CC1=CC=CC=C1C2C3=C(CCN2C(=O)CN(CCCOC)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])SC=C3

InChI

InChI=1S/C27H29N3O5S/c1-19-6-3-4-7-22(19)26-23-13-17-36-24(23)12-15-29(26)25(31)18-28(14-5-16-35-2)27(32)20-8-10-21(11-9-20)30(33)34/h3-4,6-11,13,17,26H,5,12,14-16,18H2,1-2H3