1-[5-methyl-4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]-2-(phenylmethyl)guanidine

Systemtic Name: 1-[5-methyl-4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]-2-(phenylmethyl)guanidine Openeye Name: 2-benzyl-1-[5-methyl-4-(2-methyl-1H-indol-3-yl)thiazol-2-yl]guanidine CAS Name: 1-[5-methyl-4-(2-methyl-1H-indol-3-yl)-2-thiazolyl]-2-(phenylmethyl)guanidine IUPAC Name: 2-benzyl-1-[5-methyl-4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]guanidine Traditional Name: 2-benzyl-1-[5-methyl-4-(2-methyl-1H-indol-3-yl)thiazol-2-yl]guanidine Formula: C21H21N5S MolecularWeight: 375.48994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C3=C(SC(=N3)NC(=NCC4=CC=CC=C4)N)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C3=C(SC(=N3)NC(=NCC4=CC=CC=C4)N)C

InChI

InChI=1S/C21H21N5S/c1-13-18(16-10-6-7-11-17(16)24-13)19-14(2)27-21(25-19)26-20(22)23-12-15-8-4-3-5-9-15/h3-11,24H,12H2,1-2H3,(H3,22,23,25,26)