S-[2-[[2-chloranyl-4-(2-dimethylaminoethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] N-methyl-N-naphthalen-1-yl-carbamothioate

Systemtic Name: S-[2-[[2-chloranyl-4-(2-dimethylaminoethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] N-methyl-N-naphthalen-1-yl-carbamothioate Openeye Name: S-[2-[2-chloro-4-(2-dimethylaminoethylcarbamoyl)anilino]-2-oxo-ethyl] N-methyl-N-(1-naphthyl)carbamothioate CAS Name: N-methyl-N-(1-naphthalenyl)carbamothioic acid S-[2-[2-chloro-4-[(2-dimethylaminoethylamino)-oxomethyl]anilino]-2-oxoethyl] ester IUPAC Name: S-[2-[2-chloro-4-(2-dimethylaminoethylcarbamoyl)anilino]-2-oxoethyl] N-methyl-N-naphthalen-1-ylcarbamothioate Traditional Name: N-methyl-N-(1-naphthyl)thiocarbamic acid S-[2-[2-chloro-4-(2-dimethylaminoethylcarbamoyl)anilino]-2-keto-ethyl] ester Formula: C25H27ClN4O3S MolecularWeight: 499.02488

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC(=C(C=C1)NC(=O)CSC(=O)N(C)C2=CC=CC3=CC=CC=C32)Cl

Isomeric SMILES

CN(C)CCNC(=O)C1=CC(=C(C=C1)NC(=O)CSC(=O)N(C)C2=CC=CC3=CC=CC=C32)Cl

InChI

InChI=1S/C25H27ClN4O3S/c1-29(2)14-13-27-24(32)18-11-12-21(20(26)15-18)28-23(31)16-34-25(33)30(3)22-10-6-8-17-7-4-5-9-19(17)22/h4-12,15H,13-14,16H2,1-3H3,(H,27,32)(H,28,31)