N-(2-chloranyl-6-methyl-phenyl)-2-[[5-(3-imidazol-1-ylpropylamino)-2-nitro-phenyl]amino]-1,3-thiazole-5-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-[[5-(3-imidazol-1-ylpropylamino)-2-nitro-phenyl]amino]-1,3-thiazole-5-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-[5-(3-imidazol-1-ylpropylamino)-2-nitro-anilino]thiazole-5-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[5-[3-(1-imidazolyl)propylamino]-2-nitroanilino]-5-thiazolecarboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[5-(3-imidazol-1-ylpropylamino)-2-nitroanilino]-1,3-thiazole-5-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-[5-(3-imidazol-1-ylpropylamino)-2-nitro-anilino]thiazole-5-carboxamide Formula: C23H22ClN7O3S MolecularWeight: 511.98388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=C(C=CC(=C3)NCCCN4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=C(C=CC(=C3)NCCCN4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H22ClN7O3S/c1-15-4-2-5-17(24)21(15)29-22(32)20-13-27-23(35-20)28-18-12-16(6-7-19(18)31(33)34)26-8-3-10-30-11-9-25-14-30/h2,4-7,9,11-14,26H,3,8,10H2,1H3,(H,27,28)(H,29,32)