4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[3-(phenylmethyl)-1,3-thiazol-2-ylidene]butanamide

Systemtic Name: 4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[3-(phenylmethyl)-1,3-thiazol-2-ylidene]butanamide Openeye Name: N-(3-benzylthiazol-2-ylidene)-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[3-(phenylmethyl)-2-thiazolylidene]butanamide IUPAC Name: N-(3-benzyl-1,3-thiazol-2-ylidene)-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-(3-benzyl-4-thiazolin-2-ylidene)-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C21H18N4O5S MolecularWeight: 438.45642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CSC2=NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CSC2=NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C21H18N4O5S/c26-19(22-20-23(11-12-31-20)14-15-5-2-1-3-6-15)7-4-10-24-17-9-8-16(25(28)29)13-18(17)30-21(24)27/h1-3,5-6,8-9,11-13H,4,7,10,14H2