6-[(4-chlorophenyl)sulfanylmethyl]-2-methyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine

Systemtic Name: 6-[(4-chlorophenyl)sulfanylmethyl]-2-methyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine Openeye Name: 6-[(4-chlorophenyl)sulfanylmethyl]-2-methyl-4-(1-piperidyl)-5H-pyrrolo[3,2-d]pyrimidine CAS Name: 6-[[(4-chlorophenyl)thio]methyl]-2-methyl-4-(1-piperidinyl)-5H-pyrrolo[3,2-d]pyrimidine IUPAC Name: 6-[(4-chlorophenyl)sulfanylmethyl]-2-methyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine Traditional Name: 6-[[(4-chlorophenyl)thio]methyl]-2-methyl-4-piperidino-5H-pyrrolo[3,2-d]pyrimidine Formula: C19H21ClN4S MolecularWeight: 372.91484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CCCCC3)NC(=C2)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CCCCC3)NC(=C2)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H21ClN4S/c1-13-21-17-11-15(12-25-16-7-5-14(20)6-8-16)23-18(17)19(22-13)24-9-3-2-4-10-24/h5-8,11,23H,2-4,9-10,12H2,1H3