1-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-[1-(4-oxo-1-cyclohexa-2,5-dienylidene)ethylamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-benzyl-3-[1-(4-ketocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=O)C=C1)NNC(=S)NCC2=CC=CC=C2

Isomeric SMILES

CC(=C1C=CC(=O)C=C1)NNC(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C16H17N3OS/c1-12(14-7-9-15(20)10-8-14)18-19-16(21)17-11-13-5-3-2-4-6-13/h2-10,18H,11H2,1H3,(H2,17,19,21)