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

Systemtic Name: 1-[(4-naphthalen-2-yl-4-oxidanylidene-butanoyl)amino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[[4-(2-naphthyl)-4-oxo-butanoyl]amino]thiourea CAS Name: 1-[[4-(2-naphthalenyl)-1,4-dioxobutyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(4-naphthalen-2-yl-4-oxobutanoyl)amino]thiourea Traditional Name: 1-benzyl-3-[[4-keto-4-(2-naphthyl)butanoyl]amino]thiourea Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC(=O)CCC(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC(=O)CCC(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H21N3O2S/c26-20(19-11-10-17-8-4-5-9-18(17)14-19)12-13-21(27)24-25-22(28)23-15-16-6-2-1-3-7-16/h1-11,14H,12-13,15H2,(H,24,27)(H2,23,25,28)