methyl (2S)-4-methyl-2-(10H-phenothiazin-2-ylcarbonylamino)pentanoate

Systemtic Name: methyl (2S)-4-methyl-2-(10H-phenothiazin-2-ylcarbonylamino)pentanoate Openeye Name: methyl (2S)-4-methyl-2-(10H-phenothiazine-2-carbonylamino)pentanoate CAS Name: (2S)-4-methyl-2-[[oxo(10H-phenothiazin-2-yl)methyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-4-methyl-2-(10H-phenothiazine-2-carbonylamino)pentanoate Traditional Name: (2S)-4-methyl-2-(10H-phenothiazine-2-carbonylamino)valeric acid methyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2

InChI

InChI=1S/C20H22N2O3S/c1-12(2)10-16(20(24)25-3)22-19(23)13-8-9-18-15(11-13)21-14-6-4-5-7-17(14)26-18/h4-9,11-12,16,21H,10H2,1-3H3,(H,22,23)/t16-/m0/s1