N'-[4-[[methyl(prop-2-ynyl)amino]methyl]phenyl]-6-sulfanylidene-cyclohexa-1,3-diene-1-carboximidamide

Systemtic Name: N'-[4-[[methyl(prop-2-ynyl)amino]methyl]phenyl]-6-sulfanylidene-cyclohexa-1,3-diene-1-carboximidamide Openeye Name: N'-[4-[[methyl(prop-2-ynyl)amino]methyl]phenyl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamidine CAS Name: N'-[4-[[methyl(prop-2-ynyl)amino]methyl]phenyl]-6-sulfanylidene-1-cyclohexa-1,3-dienecarboximidamide IUPAC Name: N'-[4-[[methyl(prop-2-ynyl)amino]methyl]phenyl]-6-sulfanylidenecyclohexa-1,3-diene-1-carboximidamide Traditional Name: N'-[4-[[methyl(propargyl)amino]methyl]phenyl]-6-thioxo-cyclohexa-1,3-diene-1-carboxamidine Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#C)CC1=CC=C(C=C1)N=C(C2=CC=CCC2=S)N

Isomeric SMILES

CN(CC#C)CC1=CC=C(C=C1)N=C(C2=CC=CCC2=S)N

InChI

InChI=1S/C18H19N3S/c1-3-12-21(2)13-14-8-10-15(11-9-14)20-18(19)16-6-4-5-7-17(16)22/h1,4-6,8-11H,7,12-13H2,2H3,(H2,19,20)