1-[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-cyclohexa-1,5-dien-1-yl]-3-(4-methoxyphenyl)urea CAS Name: 1-[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[(4Z)-4-(3H-1,3-benzothiazol-2-ylidene)-3-keto-cyclohexa-1,5-dien-1-yl]-3-(4-methoxyphenyl)urea Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=CC(=O)C(=C3NC4=CC=CC=C4S3)C=C2

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=CC(=O)/C(=C\3/NC4=CC=CC=C4S3)/C=C2

InChI

InChI=1S/C21H17N3O3S/c1-27-15-9-6-13(7-10-15)22-21(26)23-14-8-11-16(18(25)12-14)20-24-17-4-2-3-5-19(17)28-20/h2-12,24H,1H3,(H2,22,23,26)/b20-16-