N-(4-methoxy-2-nitro-phenyl)-2-[[6-[(2-oxidanylidenenaphthalen-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-2-[[6-[(2-oxidanylidenenaphthalen-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-2-[[6-[(2-oxo-1-naphthylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]acetamide CAS Name: N-(4-methoxy-2-nitrophenyl)-2-[[6-[(2-oxo-1-naphthalenylidene)methylamino]-1,3-benzothiazol-2-yl]thio]acetamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-2-[[6-[(2-oxonaphthalen-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[6-[(2-keto-1-naphthylidene)methylamino]-1,3-benzothiazol-2-yl]thio]-N-(4-methoxy-2-nitro-phenyl)acetamide Formula: C27H20N4O5S2 MolecularWeight: 544.6015

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC=C4C(=O)C=CC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC=C4C(=O)C=CC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C27H20N4O5S2/c1-36-18-8-10-21(23(13-18)31(34)35)29-26(33)15-37-27-30-22-9-7-17(12-25(22)38-27)28-14-20-19-5-3-2-4-16(19)6-11-24(20)32/h2-14,28H,15H2,1H3,(H,29,33)