1-[3-(3,4-dimethoxyphenyl)propanoylamino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[3-(3,4-dimethoxyphenyl)propanoylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[3-(3,4-dimethoxyphenyl)propanoylamino]-3-isopentyl-thiourea CAS Name: 1-[[3-(3,4-dimethoxyphenyl)-1-oxopropyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[3-(3,4-dimethoxyphenyl)propanoylamino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[3-(3,4-dimethoxyphenyl)propanoylamino]-3-isoamyl-thiourea Formula: C17H27N3O3S MolecularWeight: 353.47958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)CCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)CCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C17H27N3O3S/c1-12(2)9-10-18-17(24)20-19-16(21)8-6-13-5-7-14(22-3)15(11-13)23-4/h5,7,11-12H,6,8-10H2,1-4H3,(H,19,21)(H2,18,20,24)