N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]-3-(2-thioxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]-3-(2-thioxo-1,3-benzoxazol-3-yl)propionamide Formula: C23H17N3O4S MolecularWeight: 431.46378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C3C=C(C=CC3=O)NC(=O)CCN4C5=CC=CC=C5OC4=S)O2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C3C=C(C=CC3=O)NC(=O)CCN4C5=CC=CC=C5OC4=S)O2

InChI

InChI=1S/C23H17N3O4S/c27-18-10-9-14(13-15(18)22-25-16-5-1-3-7-19(16)29-22)24-21(28)11-12-26-17-6-2-4-8-20(17)30-23(26)31/h1-10,13,25H,11-12H2,(H,24,28)