4-azanyl-N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-3-nitro-benzamide

Systemtic Name: 4-azanyl-N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-3-nitro-benzamide Openeye Name: 4-amino-N-[5-[(3-chlorophenyl)methyl]thiazol-2-yl]-3-nitro-benzamide CAS Name: 4-amino-N-[5-[(3-chlorophenyl)methyl]-2-thiazolyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: 4-amino-N-[5-(3-chlorobenzyl)thiazol-2-yl]-3-nitro-benzamide Formula: C17H13ClN4O3S MolecularWeight: 388.82812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CC2=CN=C(S2)NC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CC2=CN=C(S2)NC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C17H13ClN4O3S/c18-12-3-1-2-10(6-12)7-13-9-20-17(26-13)21-16(23)11-4-5-14(19)15(8-11)22(24)25/h1-6,8-9H,7,19H2,(H,20,21,23)