N-[[4-carbamimidoyl-2-[[2-(dimethylamino)-2-oxidanylidene-ethyl]amino]phenyl]methyl]-3-methyl-benzamide

Systemtic Name: N-[[4-carbamimidoyl-2-[[2-(dimethylamino)-2-oxidanylidene-ethyl]amino]phenyl]methyl]-3-methyl-benzamide Openeye Name: N-[[4-carbamimidoyl-2-[[2-(dimethylamino)-2-oxo-ethyl]amino]phenyl]methyl]-3-methyl-benzamide CAS Name: N-[[4-carbamimidoyl-2-[[2-(dimethylamino)-2-oxoethyl]amino]phenyl]methyl]-3-methylbenzamide IUPAC Name: N-[[4-carbamimidoyl-2-[[2-(dimethylamino)-2-oxoethyl]amino]phenyl]methyl]-3-methylbenzamide Traditional Name: N-[4-amidino-2-[[2-(dimethylamino)-2-keto-ethyl]amino]benzyl]-3-methyl-benzamide Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCC(=O)N(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCC(=O)N(C)C

InChI

InChI=1S/C20H25N5O2/c1-13-5-4-6-15(9-13)20(27)24-11-16-8-7-14(19(21)22)10-17(16)23-12-18(26)25(2)3/h4-10,23H,11-12H2,1-3H3,(H3,21,22)(H,24,27)