methyl-[(3-methylthiophen-2-yl)methyl]-[3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl]azanium

Systemtic Name: methyl-[(3-methylthiophen-2-yl)methyl]-[3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl]azanium Openeye Name: [3-(benzylcarbamoylamino)-3-oxo-propyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: methyl-[(3-methyl-2-thiophenyl)methyl]-[3-oxo-3-[[oxo-[(phenylmethyl)amino]methyl]amino]propyl]ammonium IUPAC Name: [3-(benzylcarbamoylamino)-3-oxopropyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: [3-(benzylcarbamoylamino)-3-keto-propyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C18H24N3O2S+ MolecularWeight: 346.46706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](C)CCC(=O)NC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=C(SC=C1)C[NH+](C)CCC(=O)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H23N3O2S/c1-14-9-11-24-16(14)13-21(2)10-8-17(22)20-18(23)19-12-15-6-4-3-5-7-15/h3-7,9,11H,8,10,12-13H2,1-2H3,(H2,19,20,22,23)/p+1