(2S)-2-acetamido-N-(2-azanyl-2-oxidanylidene-ethyl)-3-(9-ethylcarbazol-3-yl)sulfanyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-(2-azanyl-2-oxidanylidene-ethyl)-3-(9-ethylcarbazol-3-yl)sulfanyl-propanamide Openeye Name: (2S)-2-acetamido-N-(2-amino-2-oxo-ethyl)-3-(9-ethylcarbazol-3-yl)sulfanyl-propanamide CAS Name: (2S)-2-acetamido-N-(2-amino-2-oxoethyl)-3-[(9-ethyl-3-carbazolyl)thio]propanamide IUPAC Name: (2S)-2-acetamido-N-(2-amino-2-oxoethyl)-3-(9-ethylcarbazol-3-yl)sulfanylpropanamide Traditional Name: (2S)-2-acetamido-N-(2-amino-2-keto-ethyl)-3-[(9-ethylcarbazol-3-yl)thio]propionamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)SCC(C(=O)NCC(=O)N)NC(=O)C)C3=CC=CC=C31

Isomeric SMILES

CCN1C2=C(C=C(C=C2)SC[C@H](C(=O)NCC(=O)N)NC(=O)C)C3=CC=CC=C31

InChI

InChI=1S/C21H24N4O3S/c1-3-25-18-7-5-4-6-15(18)16-10-14(8-9-19(16)25)29-12-17(24-13(2)26)21(28)23-11-20(22)27/h4-10,17H,3,11-12H2,1-2H3,(H2,22,27)(H,23,28)(H,24,26)/t17-/m1/s1