3-butyl-1-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-methyl-thiourea

Systemtic Name: 3-butyl-1-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-methyl-thiourea Openeye Name: 3-butyl-1-[(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-methyl-thiourea CAS Name: 3-butyl-1-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-1-methylthiourea IUPAC Name: 3-butyl-1-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-1-methylthiourea Traditional Name: 3-butyl-1-[(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]-1-methyl-thiourea Formula: C14H21N3O2S MolecularWeight: 295.40044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(C)NC=C1C=CC(=O)C(=C1)OC

Isomeric SMILES

CCCCNC(=S)N(C)NC=C1C=CC(=O)C(=C1)OC

InChI

InChI=1S/C14H21N3O2S/c1-4-5-8-15-14(20)17(2)16-10-11-6-7-12(18)13(9-11)19-3/h6-7,9-10,16H,4-5,8H2,1-3H3,(H,15,20)