N-[(2S)-butan-2-yl]-5-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-3-methyl-6H-1,3,4-thiadiazin-2-imine

Systemtic Name: N-[(2S)-butan-2-yl]-5-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-3-methyl-6H-1,3,4-thiadiazin-2-imine Openeye Name: 5-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-3-methyl-N-[(1S)-1-methylpropyl]-6H-1,3,4-thiadiazin-2-imine CAS Name: N-[(2S)-butan-2-yl]-5-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-3-methyl-6H-1,3,4-thiadiazin-2-imine IUPAC Name: N-[(2S)-butan-2-yl]-5-(2,5-dimethyl-1-phenylpyrrol-3-yl)-3-methyl-6H-1,3,4-thiadiazin-2-imine Traditional Name: [5-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-3-methyl-6H-1,3,4-thiadiazin-2-ylidene]-[(1S)-1-methylpropyl]amine Formula: C20H26N4S MolecularWeight: 354.51224

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N=C1N(N=C(CS1)C2=C(N(C(=C2)C)C3=CC=CC=C3)C)C

Isomeric SMILES

CC[C@H](C)N=C1N(N=C(CS1)C2=C(N(C(=C2)C)C3=CC=CC=C3)C)C

InChI

InChI=1S/C20H26N4S/c1-6-14(2)21-20-23(5)22-19(13-25-20)18-12-15(3)24(16(18)4)17-10-8-7-9-11-17/h7-12,14H,6,13H2,1-5H3/t14-/m0/s1