O-methyl N-[(3S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamothioate

Systemtic Name: O-methyl N-[(3S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamothioate Openeye Name: O-methyl N-[(3S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamothioate CAS Name: N-[(3S)-1-[4-[(2-aminoanilino)-oxomethyl]phenyl]-3-pyrrolidinyl]carbamothioic acid O-methyl ester IUPAC Name: O-methyl N-[(3S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamothioate Traditional Name: N-[(3S)-1-[4-[(2-aminophenyl)carbamoyl]phenyl]pyrrolidin-3-yl]thiocarbamic acid O-methyl ester Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)NC1CCN(C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

Isomeric SMILES

COC(=S)N[C@H]1CCN(C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

InChI

InChI=1S/C19H22N4O2S/c1-25-19(26)21-14-10-11-23(12-14)15-8-6-13(7-9-15)18(24)22-17-5-3-2-4-16(17)20/h2-9,14H,10-12,20H2,1H3,(H,21,26)(H,22,24)/t14-/m0/s1