methyl 2-[(2-chloranyl-9H-thioxanthen-9-yl)amino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(2-chloranyl-9H-thioxanthen-9-yl)amino]-3-methyl-butanoate Openeye Name: methyl 2-[(2-chloro-9H-thioxanthen-9-yl)amino]-3-methyl-butanoate CAS Name: 2-[(2-chloro-9H-thioxanthen-9-yl)amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-9H-thioxanthen-9-yl)amino]-3-methylbutanoate Traditional Name: 2-[(2-chloro-9H-thioxanthen-9-yl)amino]-3-methyl-butyric acid methyl ester Formula: C19H20ClNO2S MolecularWeight: 361.8856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl

Isomeric SMILES

CC(C)C(C(=O)OC)NC1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C19H20ClNO2S/c1-11(2)17(19(22)23-3)21-18-13-6-4-5-7-15(13)24-16-9-8-12(20)10-14(16)18/h4-11,17-18,21H,1-3H3