N-cyclohexyl-2-[(4-nitrophenyl)carbonylamino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-cyclohexyl-2-[(4-nitrophenyl)carbonylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-cyclohexyl-2-[(4-nitrobenzoyl)amino]-1,3-benzothiazole-6-carboxamide CAS Name: N-cyclohexyl-2-[[(4-nitrophenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-cyclohexyl-2-[(4-nitrobenzoyl)amino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-cyclohexyl-2-[(4-nitrobenzoyl)amino]-1,3-benzothiazole-6-carboxamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4S/c26-19(13-6-9-16(10-7-13)25(28)29)24-21-23-17-11-8-14(12-18(17)30-21)20(27)22-15-4-2-1-3-5-15/h6-12,15H,1-5H2,(H,22,27)(H,23,24,26)