N-[2-[(5-tert-butyl-4-methoxy-2-methyl-3-nitro-phenyl)carbamoyl]-1-benzothiophen-7-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-[(5-tert-butyl-4-methoxy-2-methyl-3-nitro-phenyl)carbamoyl]-1-benzothiophen-7-yl]pyridine-3-carboxamide Openeye Name: N-[2-[(5-tert-butyl-4-methoxy-2-methyl-3-nitro-phenyl)carbamoyl]benzothiophen-7-yl]pyridine-3-carboxamide CAS Name: N-[2-[(5-tert-butyl-4-methoxy-2-methyl-3-nitroanilino)-oxomethyl]-1-benzothiophen-7-yl]-3-pyridinecarboxamide IUPAC Name: N-[2-[(5-tert-butyl-4-methoxy-2-methyl-3-nitrophenyl)carbamoyl]-1-benzothiophen-7-yl]pyridine-3-carboxamide Traditional Name: N-[2-[(5-tert-butyl-4-methoxy-2-methyl-3-nitro-phenyl)carbamoyl]benzothiophen-7-yl]nicotinamide Formula: C27H26N4O5S MolecularWeight: 518.58414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)NC(=O)C2=CC3=C(S2)C(=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)NC(=O)C2=CC3=C(S2)C(=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C27H26N4O5S/c1-15-20(13-18(27(2,3)4)23(36-5)22(15)31(34)35)30-26(33)21-12-16-8-6-10-19(24(16)37-21)29-25(32)17-9-7-11-28-14-17/h6-14H,1-5H3,(H,29,32)(H,30,33)