azane; 4-[[3-[2,3-bis(chloranyl)phenyl]sulfanyl-2,3-dimethyl-4-propan-2-yl-2H-pyrrol-1-yl]methyl]pyridine

Systemtic Name: azane; 4-[[3-[2,3-bis(chloranyl)phenyl]sulfanyl-2,3-dimethyl-4-propan-2-yl-2H-pyrrol-1-yl]methyl]pyridine Openeye Name: ammonia; 4-[[3-(2,3-dichlorophenyl)sulfanyl-4-isopropyl-2,3-dimethyl-2H-pyrrol-1-yl]methyl]pyridine CAS Name: ammonia; 4-[[3-[(2,3-dichlorophenyl)thio]-2,3-dimethyl-4-propan-2-yl-2H-pyrrol-1-yl]methyl]pyridine IUPAC Name: azane; 4-[[3-(2,3-dichlorophenyl)sulfanyl-2,3-dimethyl-4-propan-2-yl-2H-pyrrol-1-yl]methyl]pyridine Traditional Name: ammonia; 4-[[3-[(2,3-dichlorophenyl)thio]-4-isopropyl-2,3-dimethyl-2-pyrrolin-1-yl]methyl]pyridine Formula: C21H27Cl2N3S MolecularWeight: 424.43018

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=CN1CC2=CC=NC=C2)C(C)C)(C)SC3=C(C(=CC=C3)Cl)Cl.N

Isomeric SMILES

CC1C(C(=CN1CC2=CC=NC=C2)C(C)C)(C)SC3=C(C(=CC=C3)Cl)Cl.N

InChI

InChI=1S/C21H24Cl2N2S.H3N/c1-14(2)17-13-25(12-16-8-10-24-11-9-16)15(3)21(17,4)26-19-7-5-6-18(22)20(19)23;/h5-11,13-15H,12H2,1-4H3;1H3