1-(3-methylphenyl)-3-[2-(naphthalen-1-ylmethylsulfanyl)ethanoylamino]thiourea

Systemtic Name: 1-(3-methylphenyl)-3-[2-(naphthalen-1-ylmethylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-(m-tolyl)-3-[[2-(1-naphthylmethylsulfanyl)acetyl]amino]thiourea CAS Name: 1-(3-methylphenyl)-3-[[2-(1-naphthalenylmethylthio)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3-methylphenyl)-3-[[2-(naphthalen-1-ylmethylsulfanyl)acetyl]amino]thiourea Traditional Name: 1-(m-tolyl)-3-[[2-(1-naphthylmethylthio)acetyl]amino]thiourea Formula: C21H21N3OS2 MolecularWeight: 395.54094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NNC(=O)CSCC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NNC(=O)CSCC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H21N3OS2/c1-15-6-4-10-18(12-15)22-21(26)24-23-20(25)14-27-13-17-9-5-8-16-7-2-3-11-19(16)17/h2-12H,13-14H2,1H3,(H,23,25)(H2,22,24,26)