1-[4-oxidanylidene-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]thiourea

Systemtic Name: 1-[4-oxidanylidene-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]thiourea Openeye Name: [3-(5-isopropyl-3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]thiourea CAS Name: [4-oxo-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)-1-cyclohexa-1,5-dienyl]thiourea IUPAC Name: [4-oxo-3-(5-propan-2-yl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-1,5-dien-1-yl]thiourea Traditional Name: [3-(5-isopropyl-3H-1,3-benzoxazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]thiourea Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)OC(=C3C=C(C=CC3=O)NC(=S)N)N2

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)OC(=C3C=C(C=CC3=O)NC(=S)N)N2

InChI

InChI=1S/C17H17N3O2S/c1-9(2)10-3-6-15-13(7-10)20-16(22-15)12-8-11(19-17(18)23)4-5-14(12)21/h3-9,20H,1-2H3,(H3,18,19,23)