1-(3-methylbutyl)-3-[(4-naphthalen-2-yl-4-oxidanylidene-butanoyl)amino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[(4-naphthalen-2-yl-4-oxidanylidene-butanoyl)amino]thiourea Openeye Name: 1-isopentyl-3-[[4-(2-naphthyl)-4-oxo-butanoyl]amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[4-(2-naphthalenyl)-1,4-dioxobutyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[(4-naphthalen-2-yl-4-oxobutanoyl)amino]thiourea Traditional Name: 1-isoamyl-3-[[4-keto-4-(2-naphthyl)butanoyl]amino]thiourea Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)CCC(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)CCC(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C20H25N3O2S/c1-14(2)11-12-21-20(26)23-22-19(25)10-9-18(24)17-8-7-15-5-3-4-6-16(15)13-17/h3-8,13-14H,9-12H2,1-2H3,(H,22,25)(H2,21,23,26)