N-[[4-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[[4-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]carbamothioyl]-2-methyl-propanamide Openeye Name: N-[[4-[3-(dimethylamino)-3-oxo-propyl]phenyl]carbamothioyl]-2-methyl-propanamide CAS Name: N-[[4-[3-(dimethylamino)-3-oxopropyl]anilino]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[[4-[3-(dimethylamino)-3-oxopropyl]phenyl]carbamothioyl]-2-methylpropanamide Traditional Name: N-[[4-[3-(dimethylamino)-3-keto-propyl]phenyl]thiocarbamoyl]-2-methyl-propionamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)CCC(=O)N(C)C

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)CCC(=O)N(C)C

InChI

InChI=1S/C16H23N3O2S/c1-11(2)15(21)18-16(22)17-13-8-5-12(6-9-13)7-10-14(20)19(3)4/h5-6,8-9,11H,7,10H2,1-4H3,(H2,17,18,21,22)