1-[[4-(4-ethoxyphenyl)-4-oxidanylidene-butanoyl]amino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[[4-(4-ethoxyphenyl)-4-oxidanylidene-butanoyl]amino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[[4-(4-ethoxyphenyl)-4-oxo-butanoyl]amino]-3-isopentyl-thiourea CAS Name: 1-[[4-(4-ethoxyphenyl)-1,4-dioxobutyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[[4-(4-ethoxyphenyl)-4-oxobutanoyl]amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-isoamyl-3-[(4-keto-4-p-phenetyl-butanoyl)amino]thiourea Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)NNC(=S)NCCC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)NNC(=S)NCCC(C)C

InChI

InChI=1S/C18H27N3O3S/c1-4-24-15-7-5-14(6-8-15)16(22)9-10-17(23)20-21-18(25)19-12-11-13(2)3/h5-8,13H,4,9-12H2,1-3H3,(H,20,23)(H2,19,21,25)